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Details

Stereochemistry ACHIRAL
Molecular Formula C12H8F3N3
Molecular Weight 251.2072
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(4-Methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)benzonitrile

SMILES

CC1=CN(C=N1)C2=CC(=CC(=C2)C#N)C(F)(F)F

InChI

InChIKey=PTMHYQUJHLKUCC-UHFFFAOYSA-N
InChI=1S/C12H8F3N3/c1-8-6-18(7-17-8)11-3-9(5-16)2-10(4-11)12(13,14)15/h2-4,6-7H,1H3

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
3-(4-Methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)benzonitrile
Systematic Name English
3-(4-Methyl-imidazol-1-yl)-5-trifluoromethyl-benzonitrile
Systematic Name English
Benzonitrile, 3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)-
Systematic Name English
Code System Code Type Description
PUBCHEM
46900393
Created by admin on Sat Dec 16 19:53:40 GMT 2023 , Edited by admin on Sat Dec 16 19:53:40 GMT 2023
PRIMARY
FDA UNII
PZ9YT69J8U
Created by admin on Sat Dec 16 19:53:40 GMT 2023 , Edited by admin on Sat Dec 16 19:53:40 GMT 2023
PRIMARY
CAS
641571-12-2
Created by admin on Sat Dec 16 19:53:40 GMT 2023 , Edited by admin on Sat Dec 16 19:53:40 GMT 2023
PRIMARY
NIH
NCATS
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